10967/76 - QDB Compounds

QsarDB Repository

Ellison, C.M.; Cronin, M.T.D.; Madden, J.C.; Schultz, T.W. Definition of the structural domain of the baseline non-polar narcosis model for Tetrahymena pyriformis. SAR QSAR Environ. Res. 2008, 19, 7-8, 751–783.

Compound

ID:368
Name:Acetaldoxime
Description:InChI code was generated with Jchem for Excel
Labels:Oxime
CAS:107-29-9
InChi Code:InChI=1S/C2H5NO/c1-2-3-4/h2,4H,1H3/b3-2+

Properties

pIGC50: 40-h Tetrahymena toxicity as log(1/IGC50) [log(L/mmol)]

ValueSource or prediction
-1.61

experimental value

-2.11

Eq2: Saturated alcohols and ketones (Test set)